2-[(5-chloro-3-pyridinyl)oxy]-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine

C15H10ClF3N4O — CID 11667540

IUPAC2-[(5-chloro-3-pyridinyl)oxy]-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine
SMILESCn1nc(-c2cccc(Oc3cncc(Cl)c3)n2)cc1C(F)(F)F
InChIInChI=1S/C15H10ClF3N4O/c1-23-13(15(17,18)19)6-12(22-23)11-3-2-4-14(21-11)24-10-5-9(16)7-20-8-10/h2-8H,1H3
InChIKeyUPNNZGIQDVENNR-UHFFFAOYSA-N
MW354.72 g/mol
LogP4.34
Rot. Bonds3

About 2-[(5-chloro-3-pyridinyl)oxy]-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine

2-[(5-chloro-3-pyridinyl)oxy]-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine (PubChem CID 11667540) has the molecular formula C15H10ClF3N4O and a molecular weight of 354.72 g/mol. Its IUPAC name is 2-[(5-chloro-3-pyridinyl)oxy]-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine.

Molecular Properties

Compound Name2-[(5-chloro-3-pyridinyl)oxy]-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine
PubChem CID11667540
Molecular FormulaC15H10ClF3N4O
Molecular Weight354.72 g/mol
Exact Mass354.05
IUPAC Name2-[(5-chloro-3-pyridinyl)oxy]-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine
SMILESCn1nc(-c2cccc(Oc3cncc(Cl)c3)n2)cc1C(F)(F)F
InChIInChI=1S/C15H10ClF3N4O/c1-23-13(15(17,18)19)6-12(22-23)11-3-2-4-14(21-11)24-10-5-9(16)7-20-8-10/h2-8H,1H3
InChIKeyUPNNZGIQDVENNR-UHFFFAOYSA-N
XLogP4.34
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.72
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-[(5-chloro-3-pyridinyl)oxy]-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(5-chloro-3-pyridinyl)oxy]-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine?
The IUPAC name of 2-[(5-chloro-3-pyridinyl)oxy]-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine (CID 11667540) is 2-[(5-chloro-3-pyridinyl)oxy]-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine.
What is the SMILES notation for 2-[(5-chloro-3-pyridinyl)oxy]-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine?
The canonical SMILES for 2-[(5-chloro-3-pyridinyl)oxy]-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine is Cn1nc(-c2cccc(Oc3cncc(Cl)c3)n2)cc1C(F)(F)F.
What is the InChIKey of 2-[(5-chloro-3-pyridinyl)oxy]-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine?
The InChIKey is UPNNZGIQDVENNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClF3N4O/c1-23-13(15(17,18)19)6-12(22-23)11-3-2-4-14(21-11)24-10-5-9(16)7-20-8-10/h2-8H,1H3.
What are the key properties of 2-[(5-chloro-3-pyridinyl)oxy]-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine?
2-[(5-chloro-3-pyridinyl)oxy]-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine has a molecular weight of 354.72 g/mol, XLogP of 4.34, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-chloro-3-pyridinyl)oxy]-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine is sourced from PubChem (CID 11667540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).